5-(2,6-dimethylmorpholin-4-yl)-N-methylpyridin-3-amine

C12H19N3O — CID 104532451

IUPAC5-(2,6-dimethylmorpholin-4-yl)-N-methylpyridin-3-amine
SMILESCNc1cncc(N2CC(C)OC(C)C2)c1
InChIInChI=1S/C12H19N3O/c1-9-7-15(8-10(2)16-9)12-4-11(13-3)5-14-6-12/h4-6,9-10,13H,7-8H2,1-3H3
InChIKeyAQIGGXVKBCVUAZ-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.74
Rot. Bonds2

About 5-(2,6-dimethylmorpholin-4-yl)-N-methylpyridin-3-amine

5-(2,6-dimethylmorpholin-4-yl)-N-methylpyridin-3-amine (PubChem CID 104532451) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 5-(2,6-dimethylmorpholin-4-yl)-N-methylpyridin-3-amine.

Molecular Properties

Compound Name5-(2,6-dimethylmorpholin-4-yl)-N-methylpyridin-3-amine
PubChem CID104532451
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name5-(2,6-dimethylmorpholin-4-yl)-N-methylpyridin-3-amine
SMILESCNc1cncc(N2CC(C)OC(C)C2)c1
InChIInChI=1S/C12H19N3O/c1-9-7-15(8-10(2)16-9)12-4-11(13-3)5-14-6-12/h4-6,9-10,13H,7-8H2,1-3H3
InChIKeyAQIGGXVKBCVUAZ-UHFFFAOYSA-N
XLogP1.74
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(2,6-dimethylmorpholin-4-yl)-N-methylpyridin-3-amine?
The IUPAC name of 5-(2,6-dimethylmorpholin-4-yl)-N-methylpyridin-3-amine (CID 104532451) is 5-(2,6-dimethylmorpholin-4-yl)-N-methylpyridin-3-amine.
What is the SMILES notation for 5-(2,6-dimethylmorpholin-4-yl)-N-methylpyridin-3-amine?
The canonical SMILES for 5-(2,6-dimethylmorpholin-4-yl)-N-methylpyridin-3-amine is CNc1cncc(N2CC(C)OC(C)C2)c1.
What is the InChIKey of 5-(2,6-dimethylmorpholin-4-yl)-N-methylpyridin-3-amine?
The InChIKey is AQIGGXVKBCVUAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-9-7-15(8-10(2)16-9)12-4-11(13-3)5-14-6-12/h4-6,9-10,13H,7-8H2,1-3H3.
What are the key properties of 5-(2,6-dimethylmorpholin-4-yl)-N-methylpyridin-3-amine?
5-(2,6-dimethylmorpholin-4-yl)-N-methylpyridin-3-amine has a molecular weight of 221.30 g/mol, XLogP of 1.74, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,6-dimethylmorpholin-4-yl)-N-methylpyridin-3-amine is sourced from PubChem (CID 104532451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).